9L1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O38 | C36 | sing | 1.43Å | 1.43Å | |
| C36 | C34 | sing | 1.55Å | 1.51Å | |
| C36 | C33 | sing | 1.53Å | 1.51Å | |
| C34 | C29 | sing | 1.53Å | 1.53Å | |
| C33 | C28 | sing | 1.53Å | 1.52Å | |
| C29 | C24 | sing | 1.53Å | 1.54Å | |
| C28 | C26 | sing | 1.55Å | 1.51Å | |
| C28 | C24 | sing | 1.53Å | 1.55Å | |
| C26 | C19 | sing | 1.53Å | 1.52Å | |
| C24 | C30 | sing | 1.53Å | 1.53Å | |
| C24 | C18 | sing | 1.53Å | 1.55Å | |
| C19 | C15 | sing | 1.53Å | 1.53Å | |
| C18 | C15 | sing | 1.54Å | 1.52Å | |
| C18 | C25 | sing | 1.52Å | 1.51Å | |
| C15 | C14 | sing | 1.52Å | 1.51Å | |
| C25 | C21 | sing | 1.54Å | 1.54Å | |
| C14 | C17 | sing | 1.53Å | 1.53Å | |
| C14 | C16 | sing | 1.55Å | 1.48Å | |
| C21 | C16 | sing | 1.52Å | 1.50Å | |
| C17 | C23 | sing | 1.55Å | 1.53Å | |
| C16 | C20 | sing | 1.53Å | 1.51Å | |
| C16 | C22 | sing | 1.53Å | 1.55Å | |
| C20 | C23 | sing | 1.55Å | 1.54Å | |
| C20 | C27 | sing | 1.53Å | 1.55Å | |
| C32 | C27 | sing | 1.53Å | 1.51Å | |
| C27 | C31 | sing | 1.53Å | 1.54Å | |
| C31 | C35 | sing | 1.53Å | 1.52Å | |
| C35 | C37 | sing | 1.51Å | 1.51Å | |
| O39 | C37 | doub | 1.21Å | 1.23Å | |
| C37 | N7 | sing | 1.35Å | 1.35Å | |
| N7 | C3 | sing | 1.40Å | 1.42Å | |
| C3 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C3 | C2 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | C5 | sing | 1.40Å | 1.39Å | Aromatic |
| O10 | C8 | doub | 1.21Å | 1.31Å | |
| C2 | C1 | doub | 1.40Å | 1.39Å | Aromatic |
| C5 | C8 | sing | 1.48Å | 1.49Å | |
| C5 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C8 | O9 | sing | 1.35Å | 1.23Å | |
| C1 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
| C1 | C11 | sing | 1.48Å | 1.49Å | |
| O12 | C11 | doub | 1.21Å | 1.23Å | |
| C11 | O13 | sing | 1.35Å | 1.31Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C6 | H2 | sing | 1.08Å | 1.08Å | |
| C15 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.09Å | 1.10Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C22 | H9 | sing | 1.09Å | 1.10Å | |
| C22 | H10 | sing | 1.09Å | 1.10Å | |
| C22 | H11 | sing | 1.09Å | 1.10Å | |
| C26 | H12 | sing | 1.09Å | 1.10Å | |
| C26 | H13 | sing | 1.09Å | 1.10Å | |
| C28 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C2 | H19 | sing | 1.08Å | 1.08Å | |
| C23 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.09Å | 1.10Å | |
| C27 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.09Å | 1.10Å | |
| C29 | H26 | sing | 1.09Å | 1.10Å | |
| C30 | H27 | sing | 1.09Å | 1.10Å | |
| C30 | H28 | sing | 1.09Å | 1.10Å | |
| C30 | H29 | sing | 1.09Å | 1.10Å | |
| C31 | H30 | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H33 | sing | 1.09Å | 1.10Å | |
| C32 | H34 | sing | 1.09Å | 1.10Å | |
| C33 | H35 | sing | 1.09Å | 1.10Å | |
| C33 | H36 | sing | 1.09Å | 1.10Å | |
| C34 | H37 | sing | 1.09Å | 1.10Å | |
| C34 | H38 | sing | 1.09Å | 1.10Å | |
| C35 | H39 | sing | 1.09Å | 1.10Å | |
| C35 | H40 | sing | 1.09Å | 1.10Å | |
| C36 | H41 | sing | 1.09Å | 1.10Å | |
| N7 | H42 | sing | 0.97Å | 1.00Å | |
| O13 | H43 | sing | 0.97Å | 0.95Å | |
| O38 | H44 | sing | 0.97Å | 0.95Å | |
| O9 | H45 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O38 | C36 | C34 | 111.0° | 109.5° |
| O38 | C36 | C33 | 109.8° | 110.1° |
| O38 | C36 | H41 | 109.3° | 109.5° |
| C36 | O38 | H44 | 109.5° | 114.0° |
| C34 | C36 | C33 | 110.2° | 109.5° |
| C36 | C34 | C29 | 110.5° | 109.8° |
| C36 | C34 | H37 | 109.2° | 109.8° |
| C36 | C34 | H38 | 109.2° | 108.8° |
| C34 | C36 | H41 | 108.3° | 109.5° |
| C36 | C33 | C28 | 112.5° | 109.4° |
| C36 | C33 | H35 | 108.7° | 109.5° |
| C36 | C33 | H36 | 108.7° | 109.5° |
| C33 | C36 | H41 | 108.2° | 108.8° |
| C34 | C29 | C24 | 113.9° | 109.5° |
| C34 | C29 | H25 | 108.4° | 109.5° |
| C34 | C29 | H26 | 108.4° | 109.5° |
| C29 | C34 | H37 | 109.2° | 109.5° |
| C29 | C34 | H38 | 109.2° | 109.5° |
| C33 | C28 | C26 | 111.3° | 109.4° |
| C33 | C28 | C24 | 113.1° | 109.8° |
| C33 | C28 | H14 | 106.9° | 109.5° |
| C28 | C33 | H35 | 108.7° | 109.5° |
| C28 | C33 | H36 | 108.7° | 109.5° |
| C29 | C24 | C28 | 108.0° | 109.4° |
| C29 | C24 | C30 | 108.3° | 109.5° |
| C29 | C24 | C18 | 111.0° | 109.5° |
| C24 | C29 | H25 | 108.4° | 109.5° |
| C24 | C29 | H26 | 108.4° | 109.5° |
| C26 | C28 | C24 | 111.6° | 109.3° |
| C28 | C26 | C19 | 110.4° | 109.3° |
| C28 | C26 | H12 | 109.3° | 109.1° |
| C28 | C26 | H13 | 109.3° | 110.1° |
| C26 | C28 | H14 | 107.0° | 109.5° |
| C28 | C24 | C30 | 109.7° | 109.5° |
| C28 | C24 | C18 | 109.4° | 109.4° |
| C24 | C28 | H14 | 106.6° | 109.4° |
| C26 | C19 | C15 | 113.0° | 109.4° |
| C19 | C26 | H12 | 109.2° | 109.4° |
| C19 | C26 | H13 | 109.2° | 109.4° |
| C26 | C19 | H17 | 108.6° | 109.4° |
| C26 | C19 | H18 | 108.6° | 109.5° |
| C30 | C24 | C18 | 110.5° | 109.5° |
| C24 | C30 | H27 | 109.5° | 109.5° |
| C24 | C30 | H28 | 109.5° | 109.4° |
| C24 | C30 | H29 | 109.5° | 109.5° |
| C24 | C18 | C15 | 113.0° | 109.2° |
| C24 | C18 | C25 | 113.1° | 110.0° |
| C24 | C18 | H16 | 106.3° | 108.8° |
| C19 | C15 | C18 | 111.1° | 110.0° |
| C19 | C15 | C14 | 110.4° | 110.4° |
| C19 | C15 | H3 | 109.0° | 109.7° |
| C15 | C19 | H17 | 108.6° | 109.5° |
| C15 | C19 | H18 | 108.6° | 109.5° |
| C15 | C18 | C25 | 110.4° | 111.6° |
| C18 | C15 | C14 | 107.9° | 107.3° |
| C18 | C15 | H3 | 109.1° | 109.7° |
| C15 | C18 | H16 | 106.7° | 108.9° |
| C18 | C25 | C21 | 114.6° | 111.4° |
| C25 | C18 | H16 | 106.9° | 108.3° |
| C18 | C25 | H22 | 108.2° | 109.1° |
| C18 | C25 | H23 | 108.2° | 109.1° |
| C15 | C14 | C17 | 118.5° | 115.8° |
| C15 | C14 | C16 | 114.9° | 107.0° |
| C14 | C15 | H3 | 109.2° | 109.7° |
| C15 | C14 | H15 | 106.2° | 110.3° |
| C25 | C21 | C16 | 116.0° | 107.3° |
| C25 | C21 | H7 | 107.8° | 109.9° |
| C25 | C21 | H8 | 107.8° | 109.9° |
| C21 | C25 | H22 | 108.2° | 109.1° |
| C21 | C25 | H23 | 108.2° | 109.1° |
| C17 | C14 | C16 | 103.8° | 101.7° |
| C14 | C17 | C23 | 103.7° | 102.9° |
| C14 | C17 | H4 | 110.9° | 110.7° |
| C14 | C17 | H5 | 110.9° | 110.9° |
| C17 | C14 | H15 | 106.1° | 110.4° |
| C14 | C16 | C21 | 112.4° | 107.4° |
| C14 | C16 | C20 | 100.8° | 103.3° |
| C14 | C16 | C22 | 106.4° | 109.8° |
| C16 | C14 | H15 | 106.6° | 111.2° |
| C21 | C16 | C20 | 122.2° | 116.6° |
| C21 | C16 | C22 | 107.9° | 109.8° |
| C16 | C21 | H7 | 107.8° | 109.9° |
| C16 | C21 | H8 | 107.8° | 109.9° |
| C17 | C23 | C20 | 105.4° | 106.3° |
| C23 | C17 | H4 | 110.9° | 110.7° |
| C23 | C17 | H5 | 110.9° | 110.7° |
| C17 | C23 | H20 | 110.5° | 110.1° |
| C17 | C23 | H21 | 110.5° | 110.1° |
| C20 | C16 | C22 | 106.0° | 109.7° |
| C16 | C20 | C23 | 104.2° | 105.3° |
| C16 | C20 | C27 | 121.6° | 110.3° |
| C16 | C20 | H6 | 106.4° | 110.3° |
| C16 | C22 | H9 | 109.5° | 109.4° |
| C16 | C22 | H10 | 109.5° | 109.5° |
| C16 | C22 | H11 | 109.5° | 109.5° |
| C23 | C20 | C27 | 111.4° | 110.3° |
| C23 | C20 | H6 | 106.1° | 110.2° |
| C20 | C23 | H20 | 110.5° | 110.0° |
| C20 | C23 | H21 | 110.5° | 110.1° |
| C20 | C27 | C32 | 114.0° | 109.5° |
| C20 | C27 | C31 | 108.3° | 109.5° |
| C27 | C20 | H6 | 106.0° | 110.2° |
| C20 | C27 | H24 | 108.0° | 109.5° |
| C32 | C27 | C31 | 109.8° | 109.5° |
| C32 | C27 | H24 | 108.4° | 109.4° |
| C27 | C32 | H32 | 109.5° | 109.5° |
| C27 | C32 | H33 | 109.5° | 109.5° |
| C27 | C32 | H34 | 109.5° | 109.4° |
| C27 | C31 | C35 | 114.1° | 109.4° |
| C31 | C27 | H24 | 108.0° | 109.5° |
| C27 | C31 | H30 | 108.3° | 109.5° |
| C27 | C31 | H31 | 108.3° | 109.5° |
| C31 | C35 | C37 | 113.2° | 109.4° |
| C35 | C31 | H30 | 108.3° | 109.5° |
| C35 | C31 | H31 | 108.3° | 109.5° |
| C31 | C35 | H39 | 108.5° | 109.5° |
| C31 | C35 | H40 | 108.5° | 109.5° |
| C35 | C37 | O39 | 122.0° | 120.0° |
| C35 | C37 | N7 | 113.5° | 120.0° |
| C37 | C35 | H39 | 108.5° | 109.4° |
| C37 | C35 | H40 | 108.5° | 109.5° |
| O39 | C37 | N7 | 124.5° | 120.0° |
| C37 | N7 | C3 | 129.9° | 120.0° |
| C37 | N7 | H42 | 115.0° | 120.0° |
| N7 | C3 | C4 | 126.3° | 119.9° |
| N7 | C3 | C2 | 114.1° | 120.0° |
| C3 | N7 | H42 | 115.0° | 120.0° |
| C4 | C3 | C2 | 119.6° | 120.1° |
| C3 | C4 | C5 | 120.3° | 120.1° |
| C3 | C4 | H1 | 119.9° | 120.0° |
| C3 | C2 | C1 | 120.6° | 120.1° |
| C3 | C2 | H19 | 119.7° | 120.0° |
| C4 | C5 | C8 | 120.4° | 120.1° |
| C4 | C5 | C6 | 119.7° | 119.9° |
| C5 | C4 | H1 | 119.8° | 119.9° |
| O10 | C8 | C5 | 115.2° | 120.0° |
| O10 | C8 | O9 | 123.2° | 120.1° |
| C2 | C1 | C6 | 119.8° | 119.9° |
| C2 | C1 | C11 | 119.7° | 120.0° |
| C1 | C2 | H19 | 119.7° | 119.9° |
| C8 | C5 | C6 | 119.9° | 120.0° |
| C5 | C8 | O9 | 121.7° | 120.0° |
| C5 | C6 | C1 | 120.1° | 119.8° |
| C5 | C6 | H2 | 119.9° | 120.1° |
| C8 | O9 | H45 | 109.5° | 116.9° |
| C6 | C1 | C11 | 120.6° | 120.1° |
| C1 | C6 | H2 | 120.0° | 120.1° |
| C1 | C11 | O12 | 121.3° | 120.0° |
| C1 | C11 | O13 | 115.0° | 120.0° |
| O12 | C11 | O13 | 123.7° | 120.0° |
| C11 | O13 | H43 | 109.5° | 117.0° |
| H4 | C17 | H5 | 109.5° | 110.6° |
| H7 | C21 | H8 | 109.5° | 109.8° |
| H9 | C22 | H10 | 109.5° | 109.5° |
| H9 | C22 | H11 | 109.5° | 109.5° |
| H10 | C22 | H11 | 109.4° | 109.5° |
| H12 | C26 | H13 | 109.4° | 109.4° |
| H17 | C19 | H18 | 109.5° | 109.5° |
| H20 | C23 | H21 | 109.5° | 110.1° |
| H22 | C25 | H23 | 109.5° | 109.0° |
| H25 | C29 | H26 | 109.5° | 109.5° |
| H27 | C30 | H28 | 109.5° | 109.4° |
| H27 | C30 | H29 | 109.5° | 109.5° |
| H28 | C30 | H29 | 109.5° | 109.5° |
| H30 | C31 | H31 | 109.5° | 109.5° |
| H32 | C32 | H33 | 109.5° | 109.5° |
| H32 | C32 | H34 | 109.5° | 109.5° |
| H33 | C32 | H34 | 109.5° | 109.5° |
| H35 | C33 | H36 | 109.5° | 109.5° |
| H37 | C34 | H38 | 109.5° | 109.4° |
| H39 | C35 | H40 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O38 | C36 | C34 | C33 | 121.8° | 120.9° |
| O38 | C36 | C34 | H41 | 119.9° | 120.0° |
| O38 | C36 | C33 | H41 | 119.2° | 119.9° |
| O38 | C36 | C34 | C29 | 178.8° | 179.9° |
| O38 | C36 | C33 | C28 | 179.0° | 179.6° |
| O38 | C36 | C33 | H35 | 60.6° | 59.6° |
| O38 | C36 | C33 | H36 | 58.5° | 60.3° |
| O38 | C36 | C34 | H37 | 58.7° | 59.6° |
| O38 | C36 | C34 | H38 | 61.1° | 60.1° |
| C34 | C36 | C33 | H41 | 118.3° | 119.6° |
| C36 | C34 | C29 | H37 | 120.1° | 120.6° |
| C36 | C34 | C29 | H38 | 120.1° | 119.4° |
| C34 | C36 | C33 | C28 | 56.4° | 59.2° |
| C36 | C34 | C29 | C24 | 57.7° | 59.4° |
| C36 | C34 | C29 | H25 | 178.4° | 60.6° |
| C36 | C34 | C29 | H26 | 62.9° | 179.4° |
| C34 | C36 | C33 | H35 | 176.9° | 60.8° |
| C34 | C36 | C33 | H36 | 64.0° | 179.2° |
| C36 | C34 | H37 | H38 | 119.5° | 119.4° |
| C34 | C36 | O38 | H44 | 180.0° | 60.0° |
| C33 | C36 | C34 | C29 | 57.0° | 59.1° |
| C36 | C33 | C28 | H35 | 120.5° | 120.0° |
| C36 | C33 | C28 | H36 | 120.5° | 120.0° |
| C36 | C33 | C28 | C26 | 178.8° | 179.9° |
| C36 | C33 | C28 | C24 | 54.6° | 60.2° |
| C36 | C33 | C28 | H14 | 62.3° | 59.9° |
| C36 | C33 | H35 | H36 | 118.6° | 120.0° |
| C33 | C36 | C34 | H37 | 63.1° | 179.5° |
| C33 | C36 | C34 | H38 | 177.1° | 60.7° |
| C33 | C36 | O38 | H44 | 57.9° | 179.5° |
| C34 | C29 | C24 | H25 | 120.7° | 120.0° |
| C34 | C29 | C24 | H26 | 120.6° | 120.0° |
| C34 | C29 | C24 | C28 | 53.2° | 60.1° |
| C34 | C29 | C24 | C30 | 171.9° | 179.9° |
| C34 | C29 | C24 | C18 | 66.8° | 59.9° |
| C34 | C29 | H25 | H26 | 118.0° | 120.0° |
| C29 | C34 | H37 | H38 | 119.5° | 120.0° |
| C29 | C34 | C36 | H41 | 61.3° | 60.1° |
| C33 | C28 | C24 | C29 | 51.0° | 60.6° |
| C33 | C28 | C26 | C24 | 127.3° | 120.2° |
| C33 | C28 | C26 | H14 | 116.4° | 120.0° |
| C33 | C28 | C24 | H14 | 117.1° | 120.2° |
| C33 | C28 | C26 | C19 | 69.3° | 60.2° |
| C33 | C28 | C24 | C30 | 168.8° | 179.4° |
| C33 | C28 | C24 | C18 | 69.9° | 59.5° |
| C33 | C28 | C26 | H12 | 170.6° | 179.8° |
| C33 | C28 | C26 | H13 | 50.8° | 60.1° |
| C28 | C33 | H35 | H36 | 118.6° | 120.1° |
| C28 | C33 | C36 | H41 | 61.8° | 60.4° |
| C29 | C24 | C28 | C26 | 177.4° | 179.5° |
| C29 | C24 | C28 | C30 | 117.8° | 120.0° |
| C29 | C24 | C28 | C18 | 120.9° | 120.0° |
| C29 | C24 | C30 | C18 | 121.7° | 120.1° |
| C29 | C24 | C18 | C15 | 172.6° | 179.6° |
| C29 | C24 | C18 | C25 | 61.1° | 56.8° |
| C29 | C24 | C28 | H14 | 66.1° | 59.6° |
| C29 | C24 | C18 | H16 | 55.9° | 61.7° |
| C24 | C29 | H25 | H26 | 118.0° | 120.0° |
| C29 | C24 | C30 | H27 | 180.0° | 60.1° |
| C29 | C24 | C30 | H28 | 60.0° | 59.9° |
| C29 | C24 | C30 | H29 | 60.0° | 179.9° |
| C24 | C29 | C34 | H37 | 62.4° | 180.0° |
| C24 | C29 | C34 | H38 | 177.9° | 60.0° |
| C26 | C28 | C24 | H14 | 116.5° | 119.8° |
| C28 | C26 | C19 | H12 | 120.2° | 119.5° |
| C28 | C26 | C19 | H13 | 120.2° | 120.6° |
| C26 | C28 | C24 | C30 | 64.8° | 59.4° |
| C26 | C28 | C24 | C18 | 56.5° | 60.5° |
| C28 | C26 | C19 | C15 | 56.2° | 59.5° |
| C28 | C26 | H12 | H13 | 119.6° | 120.5° |
| C28 | C26 | C19 | H17 | 176.7° | 60.4° |
| C28 | C26 | C19 | H18 | 64.4° | 179.6° |
| C26 | C28 | C33 | H35 | 58.4° | 60.1° |
| C26 | C28 | C33 | H36 | 60.7° | 59.9° |
| C24 | C28 | C26 | C19 | 58.1° | 60.0° |
| C28 | C24 | C30 | C18 | 120.7° | 119.9° |
| C28 | C24 | C18 | C15 | 53.5° | 60.4° |
| C28 | C24 | C18 | C25 | 179.8° | 176.8° |
| C24 | C28 | C26 | H12 | 62.1° | 59.6° |
| C24 | C28 | C26 | H13 | 178.2° | 179.7° |
| C28 | C24 | C18 | H16 | 63.2° | 58.3° |
| C28 | C24 | C29 | H25 | 173.8° | 59.9° |
| C28 | C24 | C29 | H26 | 67.5° | 179.9° |
| C28 | C24 | C30 | H27 | 62.4° | 180.0° |
| C28 | C24 | C30 | H28 | 177.6° | 60.1° |
| C28 | C24 | C30 | H29 | 57.6° | 60.0° |
| C24 | C28 | C33 | H35 | 175.1° | 59.8° |
| C24 | C28 | C33 | H36 | 65.8° | 179.8° |
| C26 | C19 | C15 | H17 | 120.5° | 119.9° |
| C26 | C19 | C15 | H18 | 120.5° | 120.1° |
| C26 | C19 | C15 | C18 | 52.9° | 59.9° |
| C26 | C19 | C15 | C14 | 172.6° | 178.1° |
| C26 | C19 | C15 | H3 | 67.4° | 60.9° |
| C19 | C26 | H12 | H13 | 119.5° | 119.9° |
| C19 | C26 | C28 | H14 | 174.3° | 179.8° |
| C26 | C19 | H17 | H18 | 118.4° | 120.1° |
| C30 | C24 | C18 | C15 | 67.3° | 59.5° |
| C30 | C24 | C18 | C25 | 59.0° | 63.3° |
| C30 | C24 | C28 | H14 | 51.7° | 60.4° |
| C30 | C24 | C18 | H16 | 176.0° | 178.2° |
| C30 | C24 | C29 | H25 | 67.5° | 60.1° |
| C30 | C24 | C29 | H26 | 51.2° | 59.9° |
| C24 | C30 | H27 | H28 | 120.0° | 119.9° |
| C24 | C30 | H27 | H29 | 120.0° | 120.0° |
| C24 | C30 | H28 | H29 | 120.0° | 120.0° |
| C24 | C18 | C15 | C19 | 51.9° | 60.2° |
| C24 | C18 | C15 | C25 | 127.8° | 121.9° |
| C24 | C18 | C15 | H16 | 116.5° | 118.7° |
| C24 | C18 | C25 | H16 | 116.6° | 118.8° |
| C24 | C18 | C15 | C14 | 173.0° | 179.7° |
| C24 | C18 | C25 | C21 | 177.8° | 176.1° |
| C24 | C18 | C15 | H3 | 68.4° | 60.6° |
| C18 | C24 | C28 | H14 | 173.0° | 179.7° |
| C24 | C18 | C25 | H22 | 61.5° | 55.7° |
| C24 | C18 | C25 | H23 | 57.0° | 63.3° |
| C18 | C24 | C29 | H25 | 53.9° | 179.9° |
| C18 | C24 | C29 | H26 | 172.6° | 60.1° |
| C18 | C24 | C30 | H27 | 58.3° | 60.0° |
| C18 | C24 | C30 | H28 | 61.7° | 180.0° |
| C18 | C24 | C30 | H29 | 178.3° | 60.0° |
| C19 | C15 | C18 | C14 | 121.2° | 120.1° |
| C19 | C15 | C18 | H3 | 120.2° | 120.8° |
| C19 | C15 | C18 | C25 | 179.6° | 177.9° |
| C19 | C15 | C14 | H3 | 119.8° | 121.0° |
| C19 | C15 | C14 | C17 | 53.6° | 63.1° |
| C19 | C15 | C14 | C16 | 177.1° | 175.6° |
| C15 | C19 | C26 | H12 | 64.0° | 60.0° |
| C15 | C19 | C26 | H13 | 176.3° | 179.9° |
| C19 | C15 | C14 | H15 | 65.4° | 63.2° |
| C19 | C15 | C18 | H16 | 64.6° | 58.5° |
| C15 | C19 | H17 | H18 | 118.4° | 120.0° |
| C15 | C18 | C25 | H16 | 115.7° | 119.8° |
| C18 | C15 | C14 | H3 | 118.5° | 119.1° |
| C15 | C18 | C25 | C21 | 50.0° | 54.7° |
| C18 | C15 | C14 | C17 | 175.3° | 177.1° |
| C18 | C15 | C14 | C16 | 61.3° | 64.5° |
| C18 | C15 | C14 | H15 | 56.2° | 56.6° |
| C18 | C15 | C19 | H17 | 173.4° | 60.0° |
| C18 | C15 | C19 | H18 | 67.7° | 180.0° |
| C15 | C18 | C25 | H22 | 170.8° | 65.7° |
| C15 | C18 | C25 | H23 | 70.7° | 175.3° |
| C25 | C18 | C15 | C14 | 59.2° | 57.9° |
| C18 | C25 | C21 | H22 | 120.8° | 120.4° |
| C18 | C25 | C21 | H23 | 120.8° | 120.6° |
| C18 | C25 | C21 | C16 | 39.4° | 57.4° |
| C25 | C18 | C15 | H3 | 59.4° | 61.3° |
| C18 | C25 | C21 | H7 | 81.5° | 176.8° |
| C18 | C25 | C21 | H8 | 160.4° | 62.2° |
| C18 | C25 | H22 | H23 | 117.7° | 119.1° |
| C15 | C14 | C17 | C16 | 128.8° | 115.6° |
| C15 | C14 | C17 | H15 | 119.2° | 126.3° |
| C15 | C14 | C16 | H15 | 117.3° | 120.6° |
| C15 | C14 | C16 | C21 | 50.2° | 69.9° |
| C15 | C14 | C17 | C23 | 163.7° | 157.2° |
| C15 | C14 | C16 | C20 | 178.2° | 166.3° |
| C15 | C14 | C16 | C22 | 67.8° | 49.4° |
| C15 | C14 | C17 | H4 | 44.7° | 38.9° |
| C15 | C14 | C17 | H5 | 77.2° | 84.3° |
| C14 | C15 | C18 | H16 | 56.5° | 61.6° |
| C14 | C15 | C19 | H17 | 66.9° | 58.2° |
| C14 | C15 | C19 | H18 | 52.1° | 61.8° |
| C25 | C21 | C16 | C14 | 37.8° | 64.4° |
| C25 | C21 | C16 | H7 | 121.0° | 119.5° |
| C25 | C21 | C16 | H8 | 120.9° | 119.6° |
| C25 | C21 | C16 | C20 | 157.7° | 179.6° |
| C25 | C21 | C16 | C22 | 79.2° | 54.9° |
| C25 | C21 | H7 | H8 | 117.0° | 121.1° |
| C21 | C25 | C18 | H16 | 65.6° | 65.1° |
| C21 | C25 | H22 | H23 | 117.6° | 119.1° |
| C17 | C14 | C16 | H15 | 111.7° | 117.5° |
| C17 | C14 | C16 | C21 | 178.9° | 168.2° |
| C14 | C17 | C23 | H4 | 119.0° | 118.3° |
| C14 | C17 | C23 | H5 | 119.1° | 118.6° |
| C17 | C14 | C16 | C20 | 47.2° | 44.4° |
| C17 | C14 | C16 | C22 | 63.2° | 72.5° |
| C14 | C17 | C23 | C20 | 8.7° | 24.0° |
| C17 | C14 | C15 | H3 | 66.2° | 57.9° |
| C14 | C17 | H4 | H5 | 122.7° | 123.4° |
| C14 | C17 | C23 | H20 | 128.1° | 143.2° |
| C14 | C17 | C23 | H21 | 110.6° | 95.2° |
| C14 | C16 | C21 | C20 | 119.9° | 115.2° |
| C14 | C16 | C21 | C22 | 117.1° | 119.3° |
| C16 | C14 | C17 | C23 | 35.0° | 41.6° |
| C14 | C16 | C20 | C22 | 110.7° | 117.0° |
| C14 | C16 | C20 | C23 | 41.1° | 29.2° |
| C14 | C16 | C20 | C27 | 167.9° | 148.2° |
| C16 | C14 | C15 | H3 | 57.2° | 54.6° |
| C16 | C14 | C17 | H4 | 84.1° | 76.7° |
| C16 | C14 | C17 | H5 | 154.0° | 160.1° |
| C14 | C16 | C20 | H6 | 70.8° | 89.7° |
| C14 | C16 | C21 | H7 | 83.1° | 176.1° |
| C14 | C16 | C21 | H8 | 158.8° | 55.2° |
| C14 | C16 | C22 | H9 | 180.0° | 62.7° |
| C14 | C16 | C22 | H10 | 60.0° | 57.3° |
| C14 | C16 | C22 | H11 | 60.0° | 177.3° |
| C21 | C16 | C20 | C22 | 124.0° | 125.5° |
| C21 | C16 | C20 | C23 | 166.4° | 146.7° |
| C21 | C16 | C20 | C27 | 66.8° | 94.3° |
| C21 | C16 | C20 | H6 | 54.5° | 27.8° |
| C16 | C21 | H7 | H8 | 117.0° | 121.0° |
| C21 | C16 | C22 | H9 | 59.1° | 55.1° |
| C21 | C16 | C22 | H10 | 60.9° | 175.1° |
| C21 | C16 | C22 | H11 | 179.2° | 64.8° |
| C21 | C16 | C14 | H15 | 67.2° | 50.7° |
| C16 | C21 | C25 | H22 | 160.2° | 63.1° |
| C16 | C21 | C25 | H23 | 81.3° | 177.9° |
| C17 | C23 | C20 | C16 | 19.7° | 3.4° |
| C17 | C23 | C20 | H20 | 119.4° | 119.2° |
| C17 | C23 | C20 | H21 | 119.4° | 119.2° |
| C17 | C23 | C20 | C27 | 152.6° | 122.4° |
| C23 | C17 | H4 | H5 | 122.7° | 123.1° |
| C17 | C23 | C20 | H6 | 92.4° | 115.6° |
| C23 | C17 | C14 | H15 | 77.1° | 76.5° |
| C17 | C23 | H20 | H21 | 122.0° | 121.6° |
| C16 | C20 | C23 | C27 | 132.9° | 119.0° |
| C16 | C20 | C23 | H6 | 112.1° | 119.0° |
| C16 | C20 | C27 | H6 | 121.5° | 122.1° |
| C16 | C20 | C27 | C32 | 52.7° | 62.6° |
| C16 | C20 | C27 | C31 | 175.3° | 177.4° |
| C20 | C16 | C21 | H7 | 36.7° | 60.9° |
| C20 | C16 | C21 | H8 | 81.4° | 60.0° |
| C20 | C16 | C22 | H9 | 73.3° | 175.6° |
| C20 | C16 | C22 | H10 | 166.7° | 55.6° |
| C20 | C16 | C22 | H11 | 46.7° | 64.5° |
| C20 | C16 | C14 | H15 | 64.5° | 73.1° |
| C16 | C20 | C23 | H20 | 99.6° | 115.8° |
| C16 | C20 | C23 | H21 | 139.1° | 122.6° |
| C16 | C20 | C27 | H24 | 67.9° | 57.3° |
| C22 | C16 | C20 | C23 | 69.6° | 87.8° |
| C22 | C16 | C20 | C27 | 57.2° | 31.2° |
| C22 | C16 | C20 | H6 | 178.5° | 153.3° |
| C22 | C16 | C21 | H7 | 159.8° | 64.5° |
| C22 | C16 | C21 | H8 | 41.7° | 174.5° |
| C16 | C22 | H9 | H10 | 120.0° | 120.0° |
| C16 | C22 | H9 | H11 | 120.0° | 120.0° |
| C16 | C22 | H10 | H11 | 120.0° | 120.0° |
| C22 | C16 | C14 | H15 | 174.9° | 170.0° |
| C23 | C20 | C27 | H6 | 115.1° | 122.0° |
| C23 | C20 | C27 | C32 | 176.1° | 178.6° |
| C23 | C20 | C27 | C31 | 61.3° | 61.4° |
| C20 | C23 | C17 | H4 | 110.3° | 94.4° |
| C20 | C23 | C17 | H5 | 127.8° | 142.6° |
| C20 | C23 | H20 | H21 | 121.9° | 121.5° |
| C23 | C20 | C27 | H24 | 55.5° | 58.6° |
| C20 | C27 | C32 | C31 | 121.7° | 120.0° |
| C20 | C27 | C32 | H24 | 120.4° | 120.0° |
| C20 | C27 | C31 | H24 | 116.8° | 120.0° |
| C20 | C27 | C31 | C35 | 171.8° | 175.0° |
| C27 | C20 | C23 | H20 | 33.2° | 3.2° |
| C27 | C20 | C23 | H21 | 88.1° | 118.3° |
| C20 | C27 | C31 | H30 | 51.2° | 55.0° |
| C20 | C27 | C31 | H31 | 67.5° | 65.0° |
| C20 | C27 | C32 | H32 | 180.0° | 59.9° |
| C20 | C27 | C32 | H33 | 60.0° | 180.0° |
| C20 | C27 | C32 | H34 | 60.0° | 60.0° |
| C32 | C27 | C31 | H24 | 118.1° | 120.0° |
| C32 | C27 | C31 | C35 | 63.1° | 65.0° |
| C32 | C27 | C20 | H6 | 68.8° | 59.5° |
| C32 | C27 | C31 | H30 | 176.3° | 175.1° |
| C32 | C27 | C31 | H31 | 57.6° | 55.0° |
| C27 | C32 | H32 | H33 | 120.0° | 120.0° |
| C27 | C32 | H32 | H34 | 120.0° | 120.0° |
| C27 | C32 | H33 | H34 | 120.0° | 120.0° |
| C27 | C31 | C35 | H30 | 120.7° | 120.0° |
| C27 | C31 | C35 | H31 | 120.7° | 120.0° |
| C27 | C31 | C35 | C37 | 163.8° | 180.0° |
| C31 | C27 | C20 | H6 | 53.8° | 60.5° |
| C27 | C31 | H30 | H31 | 117.9° | 120.0° |
| C31 | C27 | C32 | H32 | 58.3° | 179.9° |
| C31 | C27 | C32 | H33 | 61.8° | 60.0° |
| C31 | C27 | C32 | H34 | 178.3° | 60.0° |
| C27 | C31 | C35 | H39 | 75.6° | 60.1° |
| C27 | C31 | C35 | H40 | 43.2° | 60.0° |
| C31 | C35 | C37 | H39 | 120.6° | 120.0° |
| C31 | C35 | C37 | H40 | 120.6° | 120.0° |
| C31 | C35 | C37 | O39 | 36.8° | 0.0° |
| C31 | C35 | C37 | N7 | 143.1° | 180.0° |
| C35 | C31 | C27 | H24 | 55.1° | 55.0° |
| C35 | C31 | H30 | H31 | 117.9° | 120.0° |
| C31 | C35 | H39 | H40 | 118.3° | 120.0° |
| C35 | C37 | O39 | N7 | 179.9° | 180.0° |
| C35 | C37 | N7 | C3 | 179.8° | 174.6° |
| C37 | C35 | C31 | H30 | 43.1° | 60.0° |
| C37 | C35 | C31 | H31 | 75.5° | 60.0° |
| C37 | C35 | H39 | H40 | 118.3° | 120.0° |
| C35 | C37 | N7 | H42 | 0.2° | 5.3° |
| O39 | C37 | N7 | C3 | 0.3° | 5.4° |
| O39 | C37 | C35 | H39 | 157.4° | 120.0° |
| O39 | C37 | C35 | H40 | 83.7° | 120.0° |
| O39 | C37 | N7 | H42 | 179.7° | 174.7° |
| C37 | N7 | C3 | H42 | 180.0° | 179.9° |
| C37 | N7 | C3 | C4 | 1.0° | 145.3° |
| C37 | N7 | C3 | C2 | 179.0° | 35.2° |
| N7 | C37 | C35 | H39 | 22.5° | 60.0° |
| N7 | C37 | C35 | H40 | 96.4° | 60.0° |
| N7 | C3 | C4 | C2 | 180.0° | 179.5° |
| N7 | C3 | C4 | C5 | 180.0° | 180.0° |
| N7 | C3 | C2 | C1 | 179.9° | 179.9° |
| N7 | C3 | C4 | H1 | 0.0° | 0.3° |
| N7 | C3 | C2 | H19 | 0.1° | 0.2° |
| C3 | C4 | C5 | H1 | 180.0° | 179.7° |
| C4 | C3 | C2 | C1 | 0.1° | 0.6° |
| C3 | C4 | C5 | C8 | 180.0° | 179.7° |
| C3 | C4 | C5 | C6 | 0.0° | 0.3° |
| C4 | C3 | C2 | H19 | 179.9° | 179.7° |
| C4 | C3 | N7 | H42 | 179.0° | 34.8° |
| C2 | C3 | C4 | C5 | 0.0° | 0.6° |
| C3 | C2 | C1 | H19 | 180.0° | 179.7° |
| C3 | C2 | C1 | C6 | 0.2° | 0.3° |
| C3 | C2 | C1 | C11 | 179.5° | 179.7° |
| C2 | C3 | C4 | H1 | 180.0° | 179.7° |
| C2 | C3 | N7 | H42 | 1.0° | 144.6° |
| C4 | C5 | C8 | O10 | 2.4° | 0.0° |
| C4 | C5 | C8 | C6 | 179.9° | 180.0° |
| C4 | C5 | C8 | O9 | 177.4° | 180.0° |
| C4 | C5 | C6 | C1 | 0.1° | 0.0° |
| C4 | C5 | C6 | H2 | 179.8° | 180.0° |
| O10 | C8 | C5 | O9 | 179.8° | 180.0° |
| O10 | C8 | C5 | C6 | 177.5° | 180.0° |
| O10 | C8 | O9 | H45 | 0.0° | 0.0° |
| C2 | C1 | C6 | C5 | 0.2° | 0.0° |
| C2 | C1 | C6 | C11 | 179.3° | 180.0° |
| C2 | C1 | C11 | O12 | 7.6° | 0.0° |
| C2 | C1 | C11 | O13 | 171.3° | 180.0° |
| C2 | C1 | C6 | H2 | 179.8° | 180.0° |
| C8 | C5 | C6 | C1 | 179.9° | 180.0° |
| C8 | C5 | C4 | H1 | 0.0° | 0.0° |
| C8 | C5 | C6 | H2 | 0.1° | 0.0° |
| C5 | C8 | O9 | H45 | 179.8° | 180.0° |
| C6 | C5 | C8 | O9 | 2.7° | 0.0° |
| C5 | C6 | C1 | H2 | 180.0° | 179.9° |
| C5 | C6 | C1 | C11 | 179.5° | 180.0° |
| C6 | C5 | C4 | H1 | 180.0° | 180.0° |
| C6 | C1 | C11 | O12 | 171.7° | 180.0° |
| C6 | C1 | C11 | O13 | 9.4° | 0.0° |
| C6 | C1 | C2 | H19 | 179.8° | 180.0° |
| C1 | C11 | O12 | O13 | 178.7° | 179.9° |
| C11 | C1 | C6 | H2 | 0.5° | 0.0° |
| C11 | C1 | C2 | H19 | 0.5° | 0.0° |
| C1 | C11 | O13 | H43 | 178.8° | 180.0° |
| O12 | C11 | O13 | H43 | 0.0° | 0.1° |
| H3 | C15 | C14 | H15 | 174.7° | 175.8° |
| H3 | C15 | C18 | H16 | 175.2° | 179.3° |
| H3 | C15 | C19 | H17 | 53.1° | 179.2° |
| H3 | C15 | C19 | H18 | 172.1° | 59.2° |
| H4 | C17 | C14 | H15 | 163.8° | 165.2° |
| H4 | C17 | C23 | H20 | 9.0° | 24.8° |
| H4 | C17 | C23 | H21 | 130.4° | 146.4° |
| H5 | C17 | C14 | H15 | 41.9° | 42.0° |
| H5 | C17 | C23 | H20 | 112.9° | 98.3° |
| H5 | C17 | C23 | H21 | 8.5° | 23.4° |
| H6 | C20 | C23 | H20 | 148.2° | 125.2° |
| H6 | C20 | C23 | H21 | 26.9° | 3.6° |
| H6 | C20 | C27 | H24 | 170.6° | 179.4° |
| H7 | C21 | C25 | H22 | 39.3° | 56.4° |
| H7 | C21 | C25 | H23 | 157.7° | 62.6° |
| H8 | C21 | C25 | H22 | 78.8° | 177.4° |
| H8 | C21 | C25 | H23 | 39.6° | 58.4° |
| H9 | C22 | H10 | H11 | 120.0° | 120.0° |
| H12 | C26 | C28 | H14 | 54.1° | 60.2° |
| H12 | C26 | C19 | H17 | 56.5° | 179.9° |
| H12 | C26 | C19 | H18 | 175.5° | 60.1° |
| H13 | C26 | C28 | H14 | 65.6° | 60.0° |
| H13 | C26 | C19 | H17 | 63.2° | 60.2° |
| H13 | C26 | C19 | H18 | 55.8° | 59.8° |
| H14 | C28 | C33 | H35 | 58.2° | 179.9° |
| H14 | C28 | C33 | H36 | 177.3° | 60.1° |
| H16 | C18 | C25 | H22 | 55.2° | 174.5° |
| H16 | C18 | C25 | H23 | 173.6° | 55.5° |
| H24 | C27 | C31 | H30 | 65.6° | 65.0° |
| H24 | C27 | C31 | H31 | 175.7° | 175.0° |
| H24 | C27 | C32 | H32 | 59.6° | 60.0° |
| H24 | C27 | C32 | H33 | 179.6° | 60.0° |
| H24 | C27 | C32 | H34 | 60.4° | 180.0° |
| H25 | C29 | C34 | H37 | 58.3° | 60.0° |
| H25 | C29 | C34 | H38 | 61.5° | 180.0° |
| H26 | C29 | C34 | H37 | 177.0° | 60.0° |
| H26 | C29 | C34 | H38 | 57.2° | 60.0° |
| H27 | C30 | H28 | H29 | 120.0° | 120.0° |
| H30 | C31 | C35 | H39 | 163.7° | 180.0° |
| H30 | C31 | C35 | H40 | 77.4° | 60.0° |
| H31 | C31 | C35 | H39 | 45.0° | 59.9° |
| H31 | C31 | C35 | H40 | 163.9° | 180.0° |
| H32 | C32 | H33 | H34 | 120.0° | 120.0° |
| H35 | C33 | C36 | H41 | 58.6° | 179.6° |
| H36 | C33 | C36 | H41 | 177.7° | 59.6° |
| H37 | C34 | C36 | H41 | 178.6° | 60.4° |
| H38 | C34 | C36 | H41 | 58.9° | 179.9° |
| H41 | C36 | O38 | H44 | 60.6° | 60.0° |
